Basic information
- Standard SMILES
O=C(NC(CCSSCCC(NC(=O)OCc1ccccc1)C(=O)O)C(=O)O)OCc1ccccc1- InChIKey
XSFWOIRYBLESFW-UHFFFAOYSA-N- Molecular formula
- C24H28N2O8S2
- Average molar mass
- 536.6 g/mol
Names & identifiers
- Preferred name
- (2S)-4-[[3-carboxy-3-(phenylmethoxycarbonylamino)propyl]disulfanyl]-2-(phenylmethoxycarbonylamino)butanoic acid
- IUPAC
- 4-[[3-carboxy-3-(phenylmethoxycarbonylamino)propyl]disulfanyl]-2-(phenylmethoxycarbonylamino)butanoic acid
Names & synonyms
(2S)-4-[[3-carboxy-3-(phenylmethoxycarbonylamino)propyl]disulfanyl]-2-(phenylmethoxycarbonylamino)butanoic acid66076-71-9NSC266765SCHEMBL1291086XSFWOIRYBLESFW-UHFFFAOYSA-NNSC-2667654,4'-disulfanediylbis(2-(benzyloxycarbonylamino)butanoic acid)
Database identifiers
- PubChem CID
- 320239
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 202 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 17
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 642
Related reactions
2 records
Compound notes
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